AB49563

228410-90-0 | 5-Bromo-4-methyl-3-nitro-2(1H)-pyridinone

Manufacturer: A2B Chem

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CatalogNumber

AB49563

ChemicalName

5-Bromo-4-methyl-3-nitro-2(1H)-pyridinone

CasNumber

228410-90-0

MolecularFormula

C6H5BrN2O3

MolecularWeight

233.0195

MdlNumber

MFCD06659520

Smiles

[O-][N+](=O)c1c(=O)[nH]cc(c1C)Br

Complexity

313

Covalently-bondedUnitCount

1

HeavyAtomCount

12

HydrogenBondAcceptorCount

3

HydrogenBondDonorCount

1

Xlogp3

0.6

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Img

A2B Chem

AB49563

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CatalogNumber:
AB49563

ChemicalName:
5-Bromo-4-methyl-3-nitro-2(1H)-pyridinone

CasNumber:
228410-90-0

MolecularFormula:
C6H5BrN2O3

MolecularWeight:
233.0195

MdlNumber:
MFCD06659520

Smiles:
[O-][N+](=O)c1c(=O)[nH]cc(c1C)Br

Complexity:
313

Covalently-bondedUnitCount:
1

HeavyAtomCount:
12

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
1

Xlogp3:
0.6

Img

A2B Chem

AB49564

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
NCCCC[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccccc1)CCSC)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)N)CCCNC(=N)N)CCCNC(=N)N)CC(C)C)CO

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

Xlogp3:
__

Img

A2B Chem

AB49565

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CC1CC(C1)C(=O)O

Complexity:
103

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

Xlogp3:
1

Img

A2B Chem

AB49566

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CatalogNumber:
AB49566

ChemicalName:
2-Hydroxy-4,5-dimethoxybenzoic acid

CasNumber:
5722-93-0

MolecularFormula:
C9H10O5

MolecularWeight:
198.1727

MdlNumber:
MFCD19441387

Smiles:
COc1cc(C(=O)O)c(cc1OC)O

Complexity:
205

Covalently-bondedUnitCount:
1

HeavyAtomCount:
14

HydrogenBondAcceptorCount:
5

HydrogenBondDonorCount:
2

Xlogp3:
1.6